# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/c6fa8350-da40-4f21-aecf-7753f21d073c/download) ## Creator [Atsushi Togo](https://orcid.org/0000-0001-8393-9766) ## Rights Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/) ## Other metadata [Ab-initio phonon calculation for K4BeAs2 / R-3m (166) / materials id 29584](https://mdr.nims.go.jp/datasets/df0fa4d2-2325-4e16-a976-d931713fa496) ## Fulltext phonopy: version: 2.17.1 frequency_unit_conversion_factor: 15.633302 symmetry_tolerance: 1.00000e-05 nac_unit_conversion_factor: 14.399652 configuration: save_params: ".true."physical_unit: atomic_mass: "AMU" length: "angstrom" force_constants: "eV/angstrom^2"space_group: type: "R-3m" number: 166 Hall_symbol: "-R 3 2\""primitive_matrix:- [ 0.666666666666667, -0.333333333333333, -0.333333333333333 ]- [ 0.333333333333333, 0.333333333333333, -0.666666666666667 ]- [ 0.333333333333333, 0.333333333333333, 0.333333333333333 ]supercell_matrix:- [ 2, 0, 0 ]- [ 0, 2, 0 ]- [ 0, 0, 1 ]primitive_cell: lattice: - [ 2.818182030000003, 1.627078153333332, 8.589893636666659 ] # a - [ -2.818182029999997, 1.627078153333332, 8.589893636666659 ] # b - [ 0.000000000000003, -3.254156306666668, 8.589893636666659 ] # c points: - symbol: Be # 1 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 9.012182 - symbol: K # 2 coordinates: [ 0.375958540000000, 0.375958550000000, 0.375958540000000 ] mass: 39.098300 - symbol: K # 3 coordinates: [ 0.624041450000000, 0.624041460000001, 0.624041450000000 ] mass: 39.098300 - symbol: K # 4 coordinates: [ 0.791207020000000, 0.791207010000000, 0.791207020000000 ] mass: 39.098300 - symbol: K # 5 coordinates: [ 0.208792980000000, 0.208792980000001, 0.208792980000000 ] mass: 39.098300 - symbol: As # 6 coordinates: [ 0.080470800000000, 0.080470800000000, 0.080470800000000 ] mass: 74.921600 - symbol: As # 7 coordinates: [ 0.919529200000000, 0.919529190000001, 0.919529200000000 ] mass: 74.921600 reciprocal_lattice: # without 2pi - [ 0.177419341503643, 0.102433104596250, 0.038805292292616 ] # a* - [ -0.177419341503643, 0.102433104596250, 0.038805292292616 ] # b* - [ -0.000000000000000, -0.204866209192500, 0.038805292292616 ] # c*unit_cell: lattice: - [ 5.636364060000000, 0.000000000000000, 0.000000000000000 ] # a - [ -2.818182030000000, 4.881234460000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 25.769680910000002 ] # c points: - symbol: Be # 1 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 2 coordinates: [ 0.666666670000000, 0.333333330000000, 0.333333330000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 3 coordinates: [ 0.333333330000000, 0.666666670000000, 0.666666670000000 ] mass: 9.012182 reduced_to: 1 - symbol: K # 4 coordinates: [ 0.333333330000000, 0.666666670000000, 0.042625210000000 ] mass: 39.098300 reduced_to: 4 - symbol: K # 5 coordinates: [ 0.333333330000000, 0.666666670000000, 0.290708120000000 ] mass: 39.098300 reduced_to: 5 - symbol: K # 6 coordinates: [ 0.666666670000000, 0.333333330000000, 0.124540350000000 ] mass: 39.098300 reduced_to: 6 - symbol: K # 7 coordinates: [ 0.000000000000000, 0.000000000000000, 0.208792980000000 ] mass: 39.098300 reduced_to: 7 - symbol: K # 8 coordinates: [ 0.000000000000000, 0.000000000000000, 0.375958550000000 ] mass: 39.098300 reduced_to: 4 - symbol: K # 9 coordinates: [ 0.000000000000000, 0.000000000000000, 0.624041450000000 ] mass: 39.098300 reduced_to: 5 - symbol: K # 10 coordinates: [ 0.333333330000000, 0.666666670000000, 0.457873680000000 ] mass: 39.098300 reduced_to: 6 - symbol: K # 11 coordinates: [ 0.666666670000000, 0.333333330000000, 0.542126320000000 ] mass: 39.098300 reduced_to: 7 - symbol: K # 12 coordinates: [ 0.666666670000000, 0.333333330000000, 0.709291880000000 ] mass: 39.098300 reduced_to: 4 - symbol: K # 13 coordinates: [ 0.666666670000000, 0.333333330000000, 0.957374790000000 ] mass: 39.098300 reduced_to: 5 - symbol: K # 14 coordinates: [ 0.000000000000000, 0.000000000000000, 0.791207020000000 ] mass: 39.098300 reduced_to: 6 - symbol: K # 15 coordinates: [ 0.333333330000000, 0.666666670000000, 0.875459650000000 ] mass: 39.098300 reduced_to: 7 - symbol: As # 16 coordinates: [ 0.000000000000000, 0.000000000000000, 0.080470800000000 ] mass: 74.921600 reduced_to: 16 - symbol: As # 17 coordinates: [ 0.666666670000000, 0.333333330000000, 0.252862530000000 ] mass: 74.921600 reduced_to: 17 - symbol: As # 18 coordinates: [ 0.666666670000000, 0.333333330000000, 0.413804140000000 ] mass: 74.921600 reduced_to: 16 - symbol: As # 19 coordinates: [ 0.333333330000000, 0.666666670000000, 0.586195860000000 ] mass: 74.921600 reduced_to: 17 - symbol: As # 20 coordinates: [ 0.333333330000000, 0.666666670000000, 0.747137470000000 ] mass: 74.921600 reduced_to: 16 - symbol: As # 21 coordinates: [ 0.000000000000000, 0.000000000000000, 0.919529200000000 ] mass: 74.921600 reduced_to: 17supercell: lattice: - [ 11.272728120000000, 0.000000000000000, 0.000000000000000 ] # a - [ -5.636364060000000, 9.762468920000000, 0.000000000000000 ] # b - [ 0.000000000000000, 0.000000000000000, 25.769680910000002 ] # c points: - symbol: Be # 1 coordinates: [ 0.000000000000000, 0.000000000000000, 0.000000000000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 2 coordinates: [ 0.500000000000000, 0.000000000000000, 0.000000000000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 3 coordinates: [ 0.000000000000000, 0.500000000000000, 0.000000000000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 4 coordinates: [ 0.500000000000000, 0.500000000000000, 0.000000000000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 5 coordinates: [ 0.333333335000000, 0.166666665000000, 0.333333330000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 6 coordinates: [ 0.833333335000000, 0.166666665000000, 0.333333330000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 7 coordinates: [ 0.333333335000000, 0.666666665000000, 0.333333330000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 8 coordinates: [ 0.833333335000000, 0.666666665000000, 0.333333330000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 9 coordinates: [ 0.166666665000000, 0.333333335000000, 0.666666670000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 10 coordinates: [ 0.666666665000000, 0.333333335000000, 0.666666670000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 11 coordinates: [ 0.166666665000000, 0.833333335000000, 0.666666670000000 ] mass: 9.012182 reduced_to: 1 - symbol: Be # 12 coordinates: [ 0.666666665000000, 0.833333335000000, 0.666666670000000 ] mass: 9.012182 reduced_to: 1 - symbol: K # 13 coordinates: [ 0.166666665000000, 0.333333335000000, 0.042625210000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 14 coordinates: [ 0.666666665000000, 0.333333335000000, 0.042625210000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 15 coordinates: [ 0.166666665000000, 0.833333335000000, 0.042625210000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 16 coordinates: [ 0.666666665000000, 0.833333335000000, 0.042625210000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 17 coordinates: [ 0.166666665000000, 0.333333335000000, 0.290708120000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 18 coordinates: [ 0.666666665000000, 0.333333335000000, 0.290708120000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 19 coordinates: [ 0.166666665000000, 0.833333335000000, 0.290708120000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 20 coordinates: [ 0.666666665000000, 0.833333335000000, 0.290708120000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 21 coordinates: [ 0.333333335000000, 0.166666665000000, 0.124540350000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 22 coordinates: [ 0.833333335000000, 0.166666665000000, 0.124540350000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 23 coordinates: [ 0.333333335000000, 0.666666665000000, 0.124540350000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 24 coordinates: [ 0.833333335000000, 0.666666665000000, 0.124540350000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 25 coordinates: [ 0.000000000000000, 0.000000000000000, 0.208792980000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 26 coordinates: [ 0.500000000000000, 0.000000000000000, 0.208792980000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 27 coordinates: [ 0.000000000000000, 0.500000000000000, 0.208792980000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 28 coordinates: [ 0.500000000000000, 0.500000000000000, 0.208792980000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 29 coordinates: [ 0.000000000000000, 0.000000000000000, 0.375958550000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 30 coordinates: [ 0.500000000000000, 0.000000000000000, 0.375958550000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 31 coordinates: [ 0.000000000000000, 0.500000000000000, 0.375958550000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 32 coordinates: [ 0.500000000000000, 0.500000000000000, 0.375958550000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 33 coordinates: [ 0.000000000000000, 0.000000000000000, 0.624041450000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 34 coordinates: [ 0.500000000000000, 0.000000000000000, 0.624041450000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 35 coordinates: [ 0.000000000000000, 0.500000000000000, 0.624041450000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 36 coordinates: [ 0.500000000000000, 0.500000000000000, 0.624041450000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 37 coordinates: [ 0.166666665000000, 0.333333335000000, 0.457873680000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 38 coordinates: [ 0.666666665000000, 0.333333335000000, 0.457873680000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 39 coordinates: [ 0.166666665000000, 0.833333335000000, 0.457873680000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 40 coordinates: [ 0.666666665000000, 0.833333335000000, 0.457873680000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 41 coordinates: [ 0.333333335000000, 0.166666665000000, 0.542126320000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 42 coordinates: [ 0.833333335000000, 0.166666665000000, 0.542126320000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 43 coordinates: [ 0.333333335000000, 0.666666665000000, 0.542126320000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 44 coordinates: [ 0.833333335000000, 0.666666665000000, 0.542126320000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 45 coordinates: [ 0.333333335000000, 0.166666665000000, 0.709291880000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 46 coordinates: [ 0.833333335000000, 0.166666665000000, 0.709291880000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 47 coordinates: [ 0.333333335000000, 0.666666665000000, 0.709291880000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 48 coordinates: [ 0.833333335000000, 0.666666665000000, 0.709291880000000 ] mass: 39.098300 reduced_to: 13 - symbol: K # 49 coordinates: [ 0.333333335000000, 0.166666665000000, 0.957374790000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 50 coordinates: [ 0.833333335000000, 0.166666665000000, 0.957374790000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 51 coordinates: [ 0.333333335000000, 0.666666665000000, 0.957374790000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 52 coordinates: [ 0.833333335000000, 0.666666665000000, 0.957374790000000 ] mass: 39.098300 reduced_to: 17 - symbol: K # 53 coordinates: [ 0.000000000000000, 0.000000000000000, 0.791207020000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 54 coordinates: [ 0.500000000000000, 0.000000000000000, 0.791207020000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 55 coordinates: [ 0.000000000000000, 0.500000000000000, 0.791207020000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 56 coordinates: [ 0.500000000000000, 0.500000000000000, 0.791207020000000 ] mass: 39.098300 reduced_to: 21 - symbol: K # 57 coordinates: [ 0.166666665000000, 0.333333335000000, 0.875459650000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 58 coordinates: [ 0.666666665000000, 0.333333335000000, 0.875459650000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 59 coordinates: [ 0.166666665000000, 0.833333335000000, 0.875459650000000 ] mass: 39.098300 reduced_to: 25 - symbol: K # 60 coordinates: [ 0.666666665000000, 0.833333335000000, 0.875459650000000 ] mass: 39.098300 reduced_to: 25 - symbol: As # 61 coordinates: [ 0.000000000000000, 0.000000000000000, 0.080470800000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 62 coordinates: [ 0.500000000000000, 0.000000000000000, 0.080470800000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 63 coordinates: [ 0.000000000000000, 0.500000000000000, 0.080470800000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 64 coordinates: [ 0.500000000000000, 0.500000000000000, 0.080470800000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 65 coordinates: [ 0.333333335000000, 0.166666665000000, 0.252862530000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 66 coordinates: [ 0.833333335000000, 0.166666665000000, 0.252862530000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 67 coordinates: [ 0.333333335000000, 0.666666665000000, 0.252862530000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 68 coordinates: [ 0.833333335000000, 0.666666665000000, 0.252862530000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 69 coordinates: [ 0.333333335000000, 0.166666665000000, 0.413804140000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 70 coordinates: [ 0.833333335000000, 0.166666665000000, 0.413804140000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 71 coordinates: [ 0.333333335000000, 0.666666665000000, 0.413804140000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 72 coordinates: [ 0.833333335000000, 0.666666665000000, 0.413804140000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 73 coordinates: [ 0.166666665000000, 0.333333335000000, 0.586195860000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 74 coordinates: [ 0.666666665000000, 0.333333335000000, 0.586195860000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 75 coordinates: [ 0.166666665000000, 0.833333335000000, 0.586195860000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 76 coordinates: [ 0.666666665000000, 0.833333335000000, 0.586195860000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 77 coordinates: [ 0.166666665000000, 0.333333335000000, 0.747137470000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 78 coordinates: [ 0.666666665000000, 0.333333335000000, 0.747137470000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 79 coordinates: [ 0.166666665000000, 0.833333335000000, 0.747137470000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 80 coordinates: [ 0.666666665000000, 0.833333335000000, 0.747137470000000 ] mass: 74.921600 reduced_to: 61 - symbol: As # 81 coordinates: [ 0.000000000000000, 0.000000000000000, 0.919529200000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 82 coordinates: [ 0.500000000000000, 0.000000000000000, 0.919529200000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 83 coordinates: [ 0.000000000000000, 0.500000000000000, 0.919529200000000 ] mass: 74.921600 reduced_to: 65 - symbol: As # 84 coordinates: [ 0.500000000000000, 0.500000000000000, 0.919529200000000 ] mass: 74.921600 reduced_to: 65born_effective_charge:- # 1 (Be) - [ -0.809995560000000, 0.000000000000000, 0.000000000000000 ] - [ -0.000000000000000, -0.809995560000000, -0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 1.840309410000000 ]- # 2 (K) - [ 1.083361520000000, 0.000000000000000, -0.000000000000000 ] - [ 0.000000000000000, 1.083361520000000, 0.000000000000000 ] - [ -0.000000000000000, -0.000000000000000, 0.663181620000000 ]- # 3 (K) - [ 1.083361520000000, 0.000000000000000, -0.000000000000000 ] - [ 0.000000000000000, 1.083361520000000, 0.000000000000000 ] - [ -0.000000000000000, -0.000000000000000, 0.663181620000000 ]- # 4 (K) - [ 0.910028070000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 0.910028070000000, -0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 1.332942240000000 ]- # 5 (K) - [ 0.910028070000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 0.910028070000000, -0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 1.332942240000000 ]- # 6 (As) - [ -1.588391800000000, -0.000000000000000, -0.000000000000000 ] - [ -0.000000000000000, -1.588391810000000, 0.000000000000000 ] - [ -0.000000000000000, -0.000000000000000, -2.916278570000000 ]- # 7 (As) - [ -1.588391800000000, -0.000000000000000, -0.000000000000000 ] - [ -0.000000000000000, -1.588391810000001, 0.000000000000000 ] - [ -0.000000000000000, -0.000000000000000, -2.916278570000000 ]dielectric_constant: - [ 4.572748180000000, 0.000000000000000, 0.000000000000000 ] - [ 0.000000000000000, 4.572748180000000, 0.000000000000000 ] - [ 0.000000000000000, 0.000000000000000, 5.457121470000000 ]displacements:- atom: 1 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0291613300000000, 0.0000000000000000, 0.0000000000000000 ] - [ 0.0003642500000000, 0.0000000000000000, 0.0000000000000000 ] - [ -0.0000049700000000, -0.0002131800000000, -0.0000358900000000 ] - [ -0.0000049700000000, 0.0002131800000000, 0.0000358900000000 ] - [ 0.0000521000000000, 0.0000672400000000, -0.0000413600000000 ] - [ 0.0000511700000000, -0.0000669300000000, 0.0000478300000000 ] - [ 0.0000165500000000, 0.0000000600000000, -0.0000002400000000 ] - [ -0.0000645500000000, -0.0000004900000000, 0.0000002500000000 ] - [ -0.0000645500000000, 0.0000004900000000, -0.0000002500000000 ] - [ 0.0000165500000000, -0.0000000600000000, 0.0000002400000000 ] - [ 0.0000521000000000, -0.0000672400000000, 0.0000413600000000 ] - [ 0.0000511700000000, 0.0000669300000000, -0.0000478300000000 ] - [ -0.0002490800000000, -0.0000055300000000, -0.0000361000000000 ] - [ -0.0000699800000000, 0.0000001100000000, -0.0000342100000000 ] - [ 0.0030586400000000, -0.0019191800000000, 0.0016796400000000 ] - [ 0.0029984600000000, 0.0018657200000000, -0.0017175500000000 ] - [ 0.0000684300000000, 0.0000000200000000, 0.0000338300000000 ] - [ -0.0000677000000000, 0.0000004300000000, 0.0000343300000000 ] - [ -0.0000146800000000, 0.0000482100000000, -0.0000418300000000 ] - [ -0.0000139900000000, -0.0000472700000000, 0.0001099100000000 ] - [ -0.0000282000000000, -0.0002654600000000, 0.0000540500000000 ] - [ -0.0000261100000000, 0.0002684700000000, -0.0000806300000000 ] - [ -0.0000801600000000, -0.0000002300000000, -0.0000145900000000 ] - [ 0.0004353000000000, -0.0000005500000000, -0.0000133500000000 ] - [ 0.0006555300000000, 0.0000000000000000, 0.0000226200000000 ] - [ -0.0001562800000000, -0.0000001400000000, 0.0000165700000000 ] - [ -0.0000090000000000, 0.0000845800000000, 0.0000015800000000 ] - [ -0.0000088600000000, -0.0000856500000000, 0.0000308300000000 ] - [ 0.0000456700000000, -0.0000004500000000, -0.0000343700000000 ] - [ -0.0000504800000000, -0.0000001300000000, -0.0000343000000000 ] - [ 0.0000049600000000, 0.0000316100000000, -0.0000154700000000 ] - [ 0.0000055000000000, -0.0000327300000000, -0.0000530400000000 ] - [ 0.0000456700000000, 0.0000004500000000, 0.0000343700000000 ] - [ -0.0000504800000000, 0.0000001300000000, 0.0000343000000000 ] - [ 0.0000055000000000, 0.0000327300000000, 0.0000530400000000 ] - [ 0.0000049600000000, -0.0000316100000000, 0.0000154700000000 ] - [ 0.0000291100000000, 0.0000002800000000, -0.0000149700000000 ] - [ -0.0000282400000000, 0.0000004100000000, -0.0000152100000000 ] - [ -0.0000013100000000, 0.0000177500000000, -0.0000020500000000 ] - [ -0.0000010900000000, -0.0000172300000000, -0.0000279800000000 ] - [ -0.0000013100000000, -0.0000177500000000, 0.0000020500000000 ] - [ -0.0000010900000000, 0.0000172300000000, 0.0000279800000000 ] - [ -0.0000282400000000, -0.0000004100000000, 0.0000152100000000 ] - [ 0.0000291100000000, -0.0000002800000000, 0.0000149700000000 ] - [ -0.0000146800000000, -0.0000482100000000, 0.0000418300000000 ] - [ -0.0000139900000000, 0.0000472700000000, -0.0001099100000000 ] - [ -0.0000677000000000, -0.0000004300000000, -0.0000343300000000 ] - [ 0.0000684300000000, -0.0000000200000000, -0.0000338300000000 ] - [ 0.0030586400000000, 0.0019191800000000, -0.0016796400000000 ] - [ 0.0029984600000000, -0.0018657200000000, 0.0017175500000000 ] - [ -0.0000699800000000, -0.0000001100000000, 0.0000342100000000 ] - [ -0.0002490800000000, 0.0000055300000000, 0.0000361000000000 ] - [ 0.0006555300000000, 0.0000000000000000, -0.0000226200000000 ] - [ -0.0001562800000000, 0.0000001400000000, -0.0000165700000000 ] - [ -0.0000088600000000, 0.0000856500000000, -0.0000308300000000 ] - [ -0.0000090000000000, -0.0000845800000000, -0.0000015800000000 ] - [ 0.0004353000000000, 0.0000005500000000, 0.0000133500000000 ] - [ -0.0000801600000000, 0.0000002300000000, 0.0000145900000000 ] - [ -0.0000282000000000, 0.0002654600000000, -0.0000540500000000 ] - [ -0.0000261100000000, -0.0002684700000000, 0.0000806300000000 ] - [ 0.0073097000000000, 0.0000009000000000, -0.0002314400000000 ] - [ 0.0005409900000000, -0.0000009600000000, -0.0000282700000000 ] - [ 0.0000325600000000, -0.0002932900000000, 0.0000096100000000 ] - [ 0.0000321700000000, 0.0002929400000000, -0.0000654400000000 ] - [ 0.0000104200000000, 0.0000569000000000, 0.0002891700000000 ] - [ 0.0000092800000000, -0.0000550800000000, -0.0002370700000000 ] - [ 0.0000216800000000, 0.0000004200000000, 0.0000306000000000 ] - [ -0.0000860000000000, -0.0000000100000000, 0.0000354000000000 ] - [ -0.0000157500000000, -0.0000165900000000, 0.0000888900000000 ] - [ -0.0000152900000000, 0.0000147800000000, -0.0001387600000000 ] - [ 0.0000012000000000, -0.0000009900000000, -0.0000219700000000 ] - [ 0.0000108300000000, -0.0000002700000000, -0.0000166100000000 ] - [ 0.0000108300000000, 0.0000002700000000, 0.0000166100000000 ] - [ 0.0000012000000000, 0.0000009900000000, 0.0000219700000000 ] - [ -0.0000157500000000, 0.0000165900000000, -0.0000888900000000 ] - [ -0.0000152900000000, -0.0000147800000000, 0.0001387600000000 ] - [ -0.0000860000000000, 0.0000000100000000, -0.0000354000000000 ] - [ 0.0000216800000000, -0.0000004200000000, -0.0000306000000000 ] - [ 0.0000104200000000, -0.0000569000000000, -0.0002891700000000 ] - [ 0.0000092800000000, 0.0000550800000000, 0.0002370700000000 ] - [ 0.0073097000000000, -0.0000009000000000, 0.0002314400000000 ] - [ 0.0005409900000000, 0.0000009600000000, 0.0000282700000000 ] - [ 0.0000321700000000, -0.0002929400000000, 0.0000654400000000 ] - [ 0.0000325600000000, 0.0002932900000000, -0.0000096100000000 ]- atom: 1 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, -0.1864724500000000 ] - [ 0.0000000000000000, 0.0000434900000000, -0.0021834000000000 ] - [ -0.0000376600000000, -0.0000217400000000, -0.0021834000000000 ] - [ 0.0000376600000000, -0.0000217400000000, -0.0021834000000000 ] - [ -0.0000446900000000, -0.0000258000000000, 0.0003948200000000 ] - [ 0.0000446900000000, -0.0000258000000000, 0.0003948200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003086500000000 ] - [ 0.0000000000000000, 0.0000516000000000, 0.0003948200000000 ] - [ 0.0000000000000000, 0.0000524100000000, 0.0003900300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003046600000000 ] - [ 0.0000453900000000, -0.0000262000000000, 0.0003900300000000 ] - [ -0.0000453900000000, -0.0000262000000000, 0.0003900300000000 ] - [ 0.0000000000000000, 0.0016386600000000, -0.0014202800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0006232900000000 ] - [ 0.0014191300000000, -0.0008193300000000, -0.0014202800000000 ] - [ -0.0014191300000000, -0.0008193300000000, -0.0014202800000000 ] - [ 0.0000000000000000, 0.0000909100000000, 0.0002191700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001089500000000 ] - [ 0.0000787300000000, -0.0000454600000000, 0.0002191700000000 ] - [ -0.0000787300000000, -0.0000454600000000, 0.0002191700000000 ] - [ 0.0007866600000000, 0.0004541800000000, 0.0003966300000000 ] - [ -0.0007866600000000, 0.0004541800000000, 0.0003966300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000529300000000 ] - [ 0.0000000000000000, -0.0009083600000000, 0.0003966300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0016861700000000 ] - [ 0.0000000000000000, -0.0000584300000000, 0.0000758800000000 ] - [ 0.0000506000000000, 0.0000292100000000, 0.0000758800000000 ] - [ -0.0000506000000000, 0.0000292100000000, 0.0000758800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001136500000000 ] - [ 0.0000000000000000, -0.0000485200000000, 0.0001055600000000 ] - [ 0.0000420200000000, 0.0000242600000000, 0.0001055600000000 ] - [ -0.0000420200000000, 0.0000242600000000, 0.0001055600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001820300000000 ] - [ 0.0000000000000000, -0.0000487800000000, 0.0001738800000000 ] - [ 0.0000422500000000, 0.0000243900000000, 0.0001738800000000 ] - [ -0.0000422500000000, 0.0000243900000000, 0.0001738800000000 ] - [ 0.0000000000000000, 0.0000231900000000, 0.0002813000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002653800000000 ] - [ 0.0000200800000000, -0.0000116000000000, 0.0002813000000000 ] - [ -0.0000200800000000, -0.0000116000000000, 0.0002813000000000 ] - [ -0.0000202500000000, -0.0000116900000000, 0.0003128400000000 ] - [ 0.0000202500000000, -0.0000116900000000, 0.0003128400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002972000000000 ] - [ 0.0000000000000000, 0.0000233800000000, 0.0003128400000000 ] - [ -0.0000792400000000, -0.0000457500000000, 0.0001509500000000 ] - [ 0.0000792400000000, -0.0000457500000000, 0.0001509500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000399700000000 ] - [ 0.0000000000000000, 0.0000915000000000, 0.0001509500000000 ] - [ -0.0014334600000000, -0.0008276100000000, -0.0013434600000000 ] - [ 0.0014334600000000, -0.0008276100000000, -0.0013434600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005553100000000 ] - [ 0.0000000000000000, 0.0016552200000000, -0.0013434600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0016401600000000 ] - [ 0.0000000000000000, -0.0000583000000000, 0.0000421500000000 ] - [ 0.0000504900000000, 0.0000291500000000, 0.0000421500000000 ] - [ -0.0000504900000000, 0.0000291500000000, 0.0000421500000000 ] - [ 0.0000000000000000, -0.0009094900000000, 0.0004254400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000831700000000 ] - [ -0.0007876400000000, 0.0004547500000000, 0.0004254400000000 ] - [ 0.0007876400000000, 0.0004547500000000, 0.0004254400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0961457600000000 ] - [ 0.0000000000000000, -0.0000546100000000, 0.0018133500000000 ] - [ 0.0000472900000000, 0.0000273100000000, 0.0018133500000000 ] - [ -0.0000472900000000, 0.0000273100000000, 0.0018133500000000 ] - [ -0.0001511200000000, -0.0000872500000000, -0.0007965800000000 ] - [ 0.0001511200000000, -0.0000872500000000, -0.0007965800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002984100000000 ] - [ 0.0000000000000000, 0.0001745000000000, -0.0007965800000000 ] - [ 0.0000191500000000, 0.0000110500000000, -0.0007210500000000 ] - [ -0.0000191500000000, 0.0000110500000000, -0.0007210500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005232000000000 ] - [ 0.0000000000000000, -0.0000221100000000, -0.0007210500000000 ] - [ 0.0000000000000000, -0.0000220900000000, -0.0006623100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004682600000000 ] - [ -0.0000191300000000, 0.0000110400000000, -0.0006623100000000 ] - [ 0.0000191300000000, 0.0000110400000000, -0.0006623100000000 ] - [ 0.0000000000000000, 0.0001759900000000, -0.0008531000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003545000000000 ] - [ 0.0001524100000000, -0.0000879900000000, -0.0008531000000000 ] - [ -0.0001524100000000, -0.0000879900000000, -0.0008531000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0920308300000000 ] - [ 0.0000000000000000, -0.0000552200000000, 0.0018768300000000 ] - [ 0.0000478200000000, 0.0000276100000000, 0.0018768300000000 ] - [ -0.0000478200000000, 0.0000276100000000, 0.0018768300000000 ]- atom: 13 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0002488300000000, 0.0000072700000000, 0.0000033500000000 ] - [ -0.0000700200000000, 0.0000004400000000, 0.0000013200000000 ] - [ 0.0029996900000000, -0.0018692900000000, 0.0014170600000000 ] - [ 0.0030577200000000, 0.0019154800000000, -0.0014340000000000 ] - [ -0.0000141400000000, 0.0000479000000000, 0.0000828900000000 ] - [ -0.0000144100000000, -0.0000477800000000, -0.0000745700000000 ] - [ 0.0000685800000000, 0.0000000900000000, 0.0000026500000000 ] - [ -0.0000677000000000, -0.0000000800000000, 0.0000012600000000 ] - [ 0.0000458400000000, 0.0000000400000000, -0.0000011700000000 ] - [ -0.0000502300000000, -0.0000000400000000, -0.0000026700000000 ] - [ 0.0000054800000000, 0.0000320000000000, 0.0000398300000000 ] - [ 0.0000052700000000, -0.0000321500000000, -0.0000459000000000 ] - [ -0.0199473700000000, -0.0001215900000000, -0.0000736200000000 ] - [ 0.0007894200000000, 0.0000023700000000, -0.0000342700000000 ] - [ 0.0000733400000000, -0.0004140600000000, -0.0000207000000000 ] - [ 0.0000776900000000, 0.0004106300000000, -0.0000476700000000 ] - [ -0.0000899900000000, 0.0000003500000000, 0.0000347200000000 ] - [ 0.0000825500000000, 0.0000006100000000, 0.0000350800000000 ] - [ -0.0000025100000000, -0.0000487200000000, -0.0000069000000000 ] - [ -0.0000020700000000, 0.0000492900000000, 0.0000768300000000 ] - [ 0.0016762500000000, -0.0015396800000000, 0.0017712500000000 ] - [ 0.0016708100000000, 0.0015287700000000, -0.0017859700000000 ] - [ -0.0009837700000000, -0.0000039000000000, -0.0000182900000000 ] - [ 0.0006026800000000, 0.0000017000000000, -0.0000168100000000 ] - [ -0.0000626700000000, -0.0000004400000000, 0.0000154400000000 ] - [ 0.0000712800000000, -0.0000004300000000, 0.0000170300000000 ] - [ 0.0000686300000000, -0.0000760200000000, -0.0003634900000000 ] - [ 0.0000694500000000, 0.0000760100000000, 0.0003959600000000 ] - [ -0.0000465900000000, -0.0000005500000000, -0.0000347300000000 ] - [ 0.0000525200000000, -0.0000004000000000, -0.0000347900000000 ] - [ 0.0000011900000000, -0.0000281000000000, -0.0000381800000000 ] - [ 0.0000014300000000, 0.0000271900000000, -0.0000313300000000 ] - [ 0.0000231900000000, 0.0000004700000000, 0.0000348100000000 ] - [ -0.0000259400000000, 0.0000002800000000, 0.0000348700000000 ] - [ -0.0000003500000000, 0.0000142400000000, 0.0000353600000000 ] - [ -0.0000006900000000, -0.0000131600000000, 0.0000342300000000 ] - [ -0.0000266500000000, 0.0000003300000000, -0.0000159800000000 ] - [ 0.0000256300000000, 0.0000004300000000, -0.0000163200000000 ] - [ -0.0000007100000000, -0.0000149000000000, -0.0000028900000000 ] - [ -0.0000004700000000, 0.0000153900000000, -0.0000295700000000 ] - [ 0.0000006000000000, -0.0000086900000000, 0.0000344100000000 ] - [ 0.0000012100000000, 0.0000082500000000, -0.0000021800000000 ] - [ -0.0000137800000000, -0.0000006600000000, 0.0000162000000000 ] - [ 0.0000151500000000, -0.0000002900000000, 0.0000162400000000 ] - [ 0.0000011800000000, -0.0000280700000000, -0.0000582300000000 ] - [ 0.0000011700000000, 0.0000270900000000, -0.0000113900000000 ] - [ -0.0000466000000000, -0.0000003300000000, -0.0000349300000000 ] - [ 0.0000523200000000, -0.0000003500000000, -0.0000348000000000 ] - [ 0.0015860000000000, -0.0014671400000000, -0.0014594300000000 ] - [ 0.0015807100000000, 0.0014563200000000, 0.0015142800000000 ] - [ -0.0009483700000000, -0.0000034400000000, 0.0000369900000000 ] - [ 0.0006698700000000, 0.0000014200000000, 0.0000364700000000 ] - [ 0.0000392500000000, -0.0000000300000000, -0.0000156700000000 ] - [ -0.0000336400000000, 0.0000003900000000, -0.0000167100000000 ] - [ -0.0000296000000000, 0.0000400300000000, 0.0002658900000000 ] - [ -0.0000291100000000, -0.0000391900000000, -0.0002992900000000 ] - [ -0.0006376000000000, -0.0000008200000000, 0.0000200600000000 ] - [ 0.0004427200000000, -0.0000002700000000, 0.0000161300000000 ] - [ -0.0000329200000000, -0.0002743600000000, 0.0000731000000000 ] - [ -0.0000313000000000, 0.0002739100000000, -0.0000400300000000 ] - [ 0.0010584700000000, 0.0000057900000000, -0.0000075000000000 ] - [ -0.0001836600000000, 0.0000014900000000, -0.0000259900000000 ] - [ 0.0039808600000000, -0.0016824100000000, -0.0007922600000000 ] - [ 0.0041248300000000, 0.0017758600000000, 0.0007854000000000 ] - [ -0.0000167700000000, 0.0000904900000000, -0.0002755900000000 ] - [ -0.0000174500000000, -0.0000885500000000, 0.0003081300000000 ] - [ 0.0001372000000000, 0.0000005300000000, 0.0000353500000000 ] - [ -0.0001362700000000, 0.0000007200000000, 0.0000395900000000 ] - [ 0.0000026600000000, -0.0000119600000000, -0.0001584900000000 ] - [ 0.0000031900000000, 0.0000106100000000, 0.0000952600000000 ] - [ -0.0000161400000000, -0.0000009300000000, -0.0000341600000000 ] - [ 0.0000144100000000, -0.0000010800000000, -0.0000305800000000 ] - [ -0.0000049800000000, 0.0000006800000000, 0.0000018200000000 ] - [ 0.0000092700000000, 0.0000005600000000, 0.0000248100000000 ] - [ -0.0000016900000000, -0.0000039900000000, -0.0000515200000000 ] - [ -0.0000009200000000, 0.0000050800000000, 0.0001034400000000 ] - [ 0.0000947300000000, -0.0000008600000000, -0.0000251200000000 ] - [ -0.0000924500000000, -0.0000007700000000, -0.0000235500000000 ] - [ 0.0000047100000000, 0.0000555400000000, -0.0001622600000000 ] - [ 0.0000036000000000, -0.0000569900000000, 0.0001220400000000 ] - [ 0.0003563700000000, -0.0000020800000000, 0.0000172500000000 ] - [ -0.0001823500000000, 0.0000020400000000, 0.0000304900000000 ] - [ -0.0007689800000000, 0.0006481900000000, -0.0019048100000000 ] - [ -0.0007694300000000, -0.0006517100000000, 0.0019670100000000 ]- atom: 13 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0019615600000000, -0.0013754000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0005903000000000 ] - [ 0.0016987600000000, -0.0009807800000000, -0.0013754000000000 ] - [ -0.0016987600000000, -0.0009807800000000, -0.0013754000000000 ] - [ -0.0000764400000000, 0.0000441400000000, 0.0001880000000000 ] - [ 0.0000764400000000, 0.0000441400000000, 0.0001880000000000 ] - [ 0.0000000000000000, -0.0000882700000000, 0.0001880000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000746200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001451200000000 ] - [ 0.0000000000000000, -0.0000217100000000, 0.0001370800000000 ] - [ 0.0000188000000000, 0.0000108500000000, 0.0001370800000000 ] - [ -0.0000188000000000, 0.0000108500000000, 0.0001370800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0076282300000000 ] - [ 0.0000000000000000, -0.0000150900000000, -0.0002232400000000 ] - [ 0.0000130700000000, 0.0000075500000000, -0.0002232400000000 ] - [ -0.0000130700000000, 0.0000075500000000, -0.0002232400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002082800000000 ] - [ 0.0000000000000000, 0.0000486100000000, 0.0000487100000000 ] - [ -0.0000421000000000, -0.0000243000000000, 0.0000487100000000 ] - [ 0.0000421000000000, -0.0000243000000000, 0.0000487100000000 ] - [ 0.0017553300000000, -0.0010134400000000, 0.0005035200000000 ] - [ -0.0017553300000000, -0.0010134400000000, 0.0005035200000000 ] - [ 0.0000000000000000, 0.0020268800000000, 0.0005035200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000822500000000 ] - [ 0.0000000000000000, -0.0003191800000000, 0.0001331200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000586500000000 ] - [ -0.0002764200000000, 0.0001595900000000, 0.0001331200000000 ] - [ 0.0002764200000000, 0.0001595900000000, 0.0001331200000000 ] - [ 0.0000000000000000, -0.0000272700000000, 0.0000074500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000409100000000 ] - [ -0.0000236200000000, 0.0000136400000000, 0.0000074500000000 ] - [ 0.0000236200000000, 0.0000136400000000, 0.0000074500000000 ] - [ 0.0000000000000000, 0.0000005600000000, 0.0000841400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000884900000000 ] - [ 0.0000004800000000, -0.0000002800000000, 0.0000841400000000 ] - [ -0.0000004800000000, -0.0000002800000000, 0.0000841400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000917400000000 ] - [ 0.0000000000000000, 0.0000165300000000, 0.0000883400000000 ] - [ -0.0000143100000000, -0.0000082600000000, 0.0000883400000000 ] - [ 0.0000143100000000, -0.0000082600000000, 0.0000883400000000 ] - [ 0.0000018700000000, -0.0000010800000000, 0.0001253400000000 ] - [ -0.0000018700000000, -0.0000010800000000, 0.0001253400000000 ] - [ 0.0000000000000000, 0.0000021600000000, 0.0001253400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001070800000000 ] - [ -0.0000032300000000, 0.0000018600000000, 0.0000071900000000 ] - [ 0.0000032300000000, 0.0000018600000000, 0.0000071900000000 ] - [ 0.0000000000000000, -0.0000037300000000, 0.0000071900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000403800000000 ] - [ -0.0014827500000000, 0.0008560700000000, 0.0003585500000000 ] - [ 0.0014827500000000, 0.0008560700000000, 0.0003585500000000 ] - [ 0.0000000000000000, -0.0017121300000000, 0.0003585500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004245400000000 ] - [ 0.0000000000000000, -0.0000470800000000, 0.0001223700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000086700000000 ] - [ -0.0000407700000000, 0.0000235400000000, 0.0001223700000000 ] - [ 0.0000407700000000, 0.0000235400000000, 0.0001223700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0020521300000000 ] - [ 0.0000000000000000, 0.0001596800000000, 0.0001001800000000 ] - [ -0.0001382900000000, -0.0000798400000000, 0.0001001800000000 ] - [ 0.0001382900000000, -0.0000798400000000, 0.0001001800000000 ] - [ 0.0000000000000000, -0.0015850500000000, 0.0023186200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005843800000000 ] - [ -0.0013726900000000, 0.0007925200000000, 0.0023186200000000 ] - [ 0.0013726900000000, 0.0007925200000000, 0.0023186200000000 ] - [ -0.0000974300000000, 0.0000562500000000, -0.0003159300000000 ] - [ 0.0000974300000000, 0.0000562500000000, -0.0003159300000000 ] - [ 0.0000000000000000, -0.0001125000000000, -0.0003159300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000079900000000 ] - [ 0.0000193500000000, -0.0000111700000000, -0.0002848800000000 ] - [ -0.0000193500000000, -0.0000111700000000, -0.0002848800000000 ] - [ 0.0000000000000000, 0.0000223400000000, -0.0002848800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001370800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002377300000000 ] - [ 0.0000000000000000, 0.0000020800000000, -0.0001956600000000 ] - [ -0.0000018000000000, -0.0000010400000000, -0.0001956600000000 ] - [ 0.0000018000000000, -0.0000010400000000, -0.0001956600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003036600000000 ] - [ 0.0000000000000000, -0.0000306900000000, -0.0002556200000000 ] - [ 0.0000265800000000, 0.0000153400000000, -0.0002556200000000 ] - [ -0.0000265800000000, 0.0000153400000000, -0.0002556200000000 ] - [ 0.0000000000000000, -0.0014161900000000, 0.0002306600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004405600000000 ] - [ -0.0012264600000000, 0.0007081000000000, 0.0002306600000000 ] - [ 0.0012264600000000, 0.0007081000000000, 0.0002306600000000 ]- atom: 13 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0000000000000000, -0.0019608600000000, 0.0013900900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005900800000000 ] - [ -0.0016981500000000, 0.0009804300000000, 0.0013900900000000 ] - [ 0.0016981500000000, 0.0009804300000000, 0.0013900900000000 ] - [ 0.0000754000000000, -0.0000435300000000, -0.0001833500000000 ] - [ -0.0000754000000000, -0.0000435300000000, -0.0001833500000000 ] - [ 0.0000000000000000, 0.0000870600000000, -0.0001833500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000736700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001522800000000 ] - [ 0.0000000000000000, 0.0000216700000000, -0.0001419800000000 ] - [ -0.0000187600000000, -0.0000108300000000, -0.0001419800000000 ] - [ 0.0000187600000000, -0.0000108300000000, -0.0001419800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0076081700000000 ] - [ 0.0000000000000000, 0.0000165300000000, 0.0001544200000000 ] - [ -0.0000143100000000, -0.0000082600000000, 0.0001544200000000 ] - [ 0.0000143100000000, -0.0000082600000000, 0.0001544200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001372300000000 ] - [ 0.0000000000000000, -0.0000480500000000, 0.0000198400000000 ] - [ 0.0000416200000000, 0.0000240300000000, 0.0000198400000000 ] - [ -0.0000416200000000, 0.0000240300000000, 0.0000198400000000 ] - [ -0.0017462700000000, 0.0010082100000000, -0.0005432100000000 ] - [ 0.0017462700000000, 0.0010082100000000, -0.0005432100000000 ] - [ 0.0000000000000000, -0.0020164200000000, -0.0005432100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001171900000000 ] - [ 0.0000000000000000, 0.0003148300000000, -0.0001006300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000889900000000 ] - [ 0.0002726500000000, -0.0001574200000000, -0.0001006300000000 ] - [ -0.0002726500000000, -0.0001574200000000, -0.0001006300000000 ] - [ 0.0000000000000000, 0.0000270200000000, -0.0000767100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001097100000000 ] - [ 0.0000234000000000, -0.0000135100000000, -0.0000767100000000 ] - [ -0.0000234000000000, -0.0000135100000000, -0.0000767100000000 ] - [ 0.0000000000000000, -0.0000007200000000, -0.0000152500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000196700000000 ] - [ -0.0000006200000000, 0.0000003600000000, -0.0000152500000000 ] - [ 0.0000006200000000, 0.0000003600000000, -0.0000152500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001239500000000 ] - [ 0.0000000000000000, -0.0000162200000000, -0.0001199200000000 ] - [ 0.0000140500000000, 0.0000081100000000, -0.0001199200000000 ] - [ -0.0000140500000000, 0.0000081100000000, -0.0001199200000000 ] - [ -0.0000015500000000, 0.0000009000000000, -0.0000936600000000 ] - [ 0.0000015500000000, 0.0000009000000000, -0.0000936600000000 ] - [ 0.0000000000000000, -0.0000017900000000, -0.0000936600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000756800000000 ] - [ 0.0000030500000000, -0.0000017600000000, -0.0000765600000000 ] - [ -0.0000030500000000, -0.0000017600000000, -0.0000765600000000 ] - [ 0.0000000000000000, 0.0000035300000000, -0.0000765600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001095300000000 ] - [ 0.0014905000000000, -0.0008605400000000, -0.0002861900000000 ] - [ -0.0014905000000000, -0.0008605400000000, -0.0002861900000000 ] - [ 0.0000000000000000, 0.0017210800000000, -0.0002861900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004948000000000 ] - [ 0.0000000000000000, 0.0000468100000000, -0.0001541700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000407000000000 ] - [ 0.0000405400000000, -0.0000234000000000, -0.0001541700000000 ] - [ -0.0000405400000000, -0.0000234000000000, -0.0001541700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0020447500000000 ] - [ 0.0000000000000000, -0.0001589700000000, -0.0000675900000000 ] - [ 0.0001376700000000, 0.0000794800000000, -0.0000675900000000 ] - [ -0.0001376700000000, 0.0000794800000000, -0.0000675900000000 ] - [ 0.0000000000000000, 0.0015735900000000, -0.0023712900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0006301200000000 ] - [ 0.0013627700000000, -0.0007868000000000, -0.0023712900000000 ] - [ -0.0013627700000000, -0.0007868000000000, -0.0023712900000000 ] - [ 0.0000963200000000, -0.0000556100000000, 0.0003572500000000 ] - [ -0.0000963200000000, -0.0000556100000000, 0.0003572500000000 ] - [ 0.0000000000000000, 0.0001112200000000, 0.0003572500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000560400000000 ] - [ -0.0000193100000000, 0.0000111500000000, 0.0002404200000000 ] - [ 0.0000193100000000, 0.0000111500000000, 0.0002404200000000 ] - [ 0.0000000000000000, -0.0000223000000000, 0.0002404200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001150300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002228200000000 ] - [ 0.0000000000000000, -0.0000018500000000, 0.0002526900000000 ] - [ 0.0000016000000000, 0.0000009200000000, 0.0002526900000000 ] - [ -0.0000016000000000, 0.0000009200000000, 0.0002526900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002579600000000 ] - [ 0.0000000000000000, 0.0000305900000000, 0.0002088900000000 ] - [ -0.0000265000000000, -0.0000153000000000, 0.0002088900000000 ] - [ 0.0000265000000000, -0.0000153000000000, 0.0002088900000000 ] - [ 0.0000000000000000, 0.0014213100000000, -0.0001967400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003884700000000 ] - [ 0.0012308900000000, -0.0007106500000000, -0.0001967400000000 ] - [ -0.0012308900000000, -0.0007106500000000, -0.0001967400000000 ]- atom: 21 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ -0.0000314600000000, -0.0002687600000000, 0.0007890100000000 ] - [ -0.0000226600000000, 0.0002651900000000, -0.0007851400000000 ] - [ -0.0000802100000000, -0.0000004700000000, -0.0000019100000000 ] - [ 0.0004353900000000, 0.0000009900000000, -0.0000006500000000 ] - [ 0.0006558100000000, -0.0000008000000000, -0.0000008100000000 ] - [ -0.0001564500000000, 0.0000002100000000, 0.0000010000000000 ] - [ -0.0000089200000000, 0.0000852300000000, 0.0000499000000000 ] - [ -0.0000087900000000, -0.0000852100000000, -0.0000503100000000 ] - [ -0.0000012200000000, 0.0000175300000000, 0.0000130800000000 ] - [ -0.0000009500000000, -0.0000175200000000, -0.0000263100000000 ] - [ 0.0000292700000000, -0.0000001200000000, -0.0000066200000000 ] - [ -0.0000281500000000, 0.0000000600000000, -0.0000064800000000 ] - [ 0.0016717800000000, -0.0015290100000000, 0.0017054400000000 ] - [ 0.0016782000000000, 0.0015392600000000, -0.0017960300000000 ] - [ -0.0009821000000000, 0.0000037900000000, -0.0000345000000000 ] - [ 0.0006040800000000, -0.0000015700000000, -0.0000376400000000 ] - [ 0.0000685400000000, -0.0000753900000000, -0.0002400600000000 ] - [ 0.0000668900000000, 0.0000767000000000, 0.0003091200000000 ] - [ -0.0000639900000000, 0.0000011300000000, 0.0000333300000000 ] - [ 0.0000700000000000, -0.0000001100000000, 0.0000334700000000 ] - [ -0.0140377400000000, 0.0000890800000000, 0.0000546400000000 ] - [ 0.0008345800000000, -0.0000012300000000, -0.0000190300000000 ] - [ 0.0000667600000000, -0.0004427000000000, 0.0001066000000000 ] - [ 0.0000649100000000, 0.0004452000000000, -0.0001436200000000 ] - [ 0.0014706600000000, 0.0012195400000000, -0.0016960500000000 ] - [ 0.0014765600000000, -0.0012331600000000, 0.0017403600000000 ] - [ 0.0000116400000000, 0.0000001600000000, 0.0000153600000000 ] - [ -0.0006504100000000, -0.0000055600000000, 0.0000116200000000 ] - [ -0.0000272200000000, -0.0000402100000000, 0.0000038000000000 ] - [ -0.0000286700000000, 0.0000395300000000, -0.0000772200000000 ] - [ -0.0000325900000000, -0.0000001800000000, -0.0000366800000000 ] - [ 0.0000410500000000, -0.0000009600000000, -0.0000368300000000 ] - [ -0.0000005800000000, 0.0000089900000000, 0.0000311600000000 ] - [ -0.0000003700000000, -0.0000080500000000, 0.0000347400000000 ] - [ 0.0000138500000000, 0.0000004300000000, 0.0000329700000000 ] - [ -0.0000152300000000, 0.0000005200000000, 0.0000329600000000 ] - [ -0.0000009700000000, -0.0000096300000000, -0.0000022700000000 ] - [ -0.0000017400000000, 0.0000102600000000, -0.0000337700000000 ] - [ -0.0000186100000000, 0.0000005900000000, -0.0000180600000000 ] - [ 0.0000144800000000, 0.0000001700000000, -0.0000178800000000 ] - [ -0.0000200500000000, -0.0000002900000000, 0.0000140900000000 ] - [ 0.0000142300000000, -0.0000003900000000, 0.0000145200000000 ] - [ 0.0000009800000000, -0.0000080100000000, 0.0000243100000000 ] - [ 0.0000008500000000, 0.0000073400000000, 0.0000042800000000 ] - [ -0.0000253900000000, -0.0000003100000000, -0.0000365000000000 ] - [ 0.0000268400000000, -0.0000004700000000, -0.0000366500000000 ] - [ 0.0000007100000000, -0.0000155400000000, -0.0000508000000000 ] - [ 0.0000005300000000, 0.0000147100000000, -0.0000224400000000 ] - [ -0.0006392700000000, 0.0000007200000000, 0.0000347300000000 ] - [ 0.0004413800000000, -0.0000006800000000, 0.0000333300000000 ] - [ -0.0000325500000000, -0.0002733500000000, -0.0001047000000000 ] - [ -0.0000348900000000, 0.0002751600000000, 0.0001713000000000 ] - [ -0.0000013700000000, 0.0000103000000000, 0.0001198000000000 ] - [ -0.0000015200000000, -0.0000094000000000, -0.0001557300000000 ] - [ 0.0000141800000000, 0.0000003600000000, -0.0000181700000000 ] - [ -0.0000184600000000, 0.0000003200000000, -0.0000176300000000 ] - [ -0.0000029600000000, -0.0001287300000000, 0.0000584600000000 ] - [ -0.0000036100000000, 0.0001281000000000, -0.0000289300000000 ] - [ -0.0002255100000000, -0.0000002000000000, 0.0000147700000000 ] - [ 0.0002308500000000, -0.0000006400000000, 0.0000150400000000 ] - [ 0.0031076900000000, 0.0012563900000000, 0.0006477700000000 ] - [ 0.0032212800000000, -0.0013320700000000, -0.0007571600000000 ] - [ -0.0002440500000000, -0.0000021300000000, -0.0000368800000000 ] - [ 0.0009225200000000, -0.0000075300000000, -0.0000224900000000 ] - [ 0.0007796800000000, -0.0000005800000000, 0.0000198500000000 ] - [ -0.0003421200000000, 0.0000000400000000, 0.0000250100000000 ] - [ -0.0000110700000000, 0.0001923700000000, -0.0001053100000000 ] - [ -0.0000108900000000, -0.0001903700000000, 0.0001524400000000 ] - [ -0.0001989700000000, 0.0000000100000000, 0.0000078500000000 ] - [ 0.0000443400000000, -0.0000008000000000, -0.0000265200000000 ] - [ 0.0000027700000000, -0.0000256000000000, -0.0000847700000000 ] - [ 0.0000022000000000, 0.0000238300000000, 0.0000457800000000 ] - [ 0.0000002600000000, -0.0000014700000000, 0.0000069800000000 ] - [ 0.0000002100000000, 0.0000021300000000, 0.0000593700000000 ] - [ -0.0000023900000000, 0.0000006300000000, 0.0000336100000000 ] - [ 0.0000043300000000, 0.0000003100000000, 0.0000482700000000 ] - [ -0.0000000900000000, 0.0000291200000000, -0.0000776100000000 ] - [ -0.0000004200000000, -0.0000293000000000, 0.0000324600000000 ] - [ 0.0000508900000000, -0.0000006400000000, -0.0000147000000000 ] - [ -0.0000509900000000, -0.0000004700000000, -0.0000064900000000 ] - [ 0.0000054100000000, 0.0000498500000000, -0.0010742200000000 ] - [ 0.0000025800000000, -0.0000474400000000, 0.0011087700000000 ] - [ -0.0000040400000000, 0.0000009200000000, 0.0000310900000000 ] - [ -0.0000795200000000, -0.0000001100000000, 0.0000230800000000 ]- atom: 21 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000668100000000, 0.0000385700000000, 0.0004145200000000 ] - [ -0.0000668100000000, 0.0000385700000000, 0.0004145200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000678700000000 ] - [ 0.0000000000000000, -0.0000771400000000, 0.0004145200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0016806900000000 ] - [ 0.0000000000000000, 0.0000169000000000, 0.0000605500000000 ] - [ -0.0000146300000000, -0.0000084500000000, 0.0000605500000000 ] - [ 0.0000146300000000, -0.0000084500000000, 0.0000605500000000 ] - [ 0.0000128000000000, -0.0000073900000000, 0.0002939300000000 ] - [ -0.0000128000000000, -0.0000073900000000, 0.0002939300000000 ] - [ 0.0000000000000000, 0.0000147800000000, 0.0002939300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002779600000000 ] - [ 0.0017743300000000, -0.0010244100000000, 0.0004908400000000 ] - [ -0.0017743300000000, -0.0010244100000000, 0.0004908400000000 ] - [ 0.0000000000000000, 0.0020488200000000, 0.0004908400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000645800000000 ] - [ -0.0003797600000000, 0.0002192500000000, 0.0001511500000000 ] - [ 0.0003797600000000, 0.0002192500000000, 0.0001511500000000 ] - [ 0.0000000000000000, -0.0004385000000000, 0.0001511500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000402700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0178497500000000 ] - [ 0.0000000000000000, -0.0001448600000000, -0.0005687900000000 ] - [ 0.0001254500000000, 0.0000724300000000, -0.0005687900000000 ] - [ -0.0001254500000000, 0.0000724300000000, -0.0005687900000000 ] - [ -0.0017227400000000, -0.0009946200000000, 0.0000141400000000 ] - [ 0.0017227400000000, -0.0009946200000000, 0.0000141400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004440000000000 ] - [ 0.0000000000000000, 0.0019892500000000, 0.0000141400000000 ] - [ -0.0002828400000000, -0.0001633000000000, 0.0001028500000000 ] - [ 0.0002828400000000, -0.0001633000000000, 0.0001028500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000107000000000 ] - [ 0.0000000000000000, 0.0003265900000000, 0.0001028500000000 ] - [ -0.0000182500000000, -0.0000105400000000, 0.0001431600000000 ] - [ 0.0000182500000000, -0.0000105400000000, 0.0001431600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001250300000000 ] - [ 0.0000000000000000, 0.0000210700000000, 0.0001431600000000 ] - [ -0.0001378000000000, 0.0000795600000000, 0.0002180700000000 ] - [ 0.0001378000000000, 0.0000795600000000, 0.0002180700000000 ] - [ 0.0000000000000000, -0.0001591200000000, 0.0002180700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001714300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003770100000000 ] - [ 0.0000000000000000, -0.0000113300000000, 0.0001888200000000 ] - [ 0.0000098100000000, 0.0000056600000000, 0.0001888200000000 ] - [ -0.0000098100000000, 0.0000056600000000, 0.0001888200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000728900000000 ] - [ 0.0000000000000000, -0.0000153600000000, 0.0000695600000000 ] - [ 0.0000133000000000, 0.0000076800000000, 0.0000695600000000 ] - [ -0.0000133000000000, 0.0000076800000000, 0.0000695600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0020705500000000 ] - [ 0.0000000000000000, -0.0000658400000000, 0.0001193500000000 ] - [ 0.0000570200000000, 0.0000329200000000, 0.0001193500000000 ] - [ -0.0000570200000000, 0.0000329200000000, 0.0001193500000000 ] - [ -0.0000155300000000, -0.0000089700000000, 0.0002184400000000 ] - [ 0.0000155300000000, -0.0000089700000000, 0.0002184400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001717600000000 ] - [ 0.0000000000000000, 0.0000179300000000, 0.0002184400000000 ] - [ 0.0000434000000000, -0.0000250600000000, 0.0002655300000000 ] - [ -0.0000434000000000, -0.0000250600000000, 0.0002655300000000 ] - [ 0.0000000000000000, 0.0000501100000000, 0.0002655300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002562500000000 ] - [ 0.0008264500000000, 0.0004771500000000, 0.0016542000000000 ] - [ -0.0008264500000000, 0.0004771500000000, 0.0016542000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003839800000000 ] - [ 0.0000000000000000, -0.0009543000000000, 0.0016542000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0071884300000000 ] - [ 0.0000000000000000, 0.0000123600000000, 0.0003691700000000 ] - [ -0.0000107000000000, -0.0000061800000000, 0.0003691700000000 ] - [ 0.0000107000000000, -0.0000061800000000, 0.0003691700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0017405900000000 ] - [ 0.0000000000000000, -0.0000059800000000, -0.0001182800000000 ] - [ 0.0000051800000000, 0.0000029900000000, -0.0001182800000000 ] - [ -0.0000051800000000, 0.0000029900000000, -0.0001182800000000 ] - [ 0.0000326200000000, -0.0000188300000000, -0.0004536100000000 ] - [ -0.0000326200000000, -0.0000188300000000, -0.0004536100000000 ] - [ 0.0000000000000000, 0.0000376700000000, -0.0004536100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003953900000000 ] - [ -0.0000114500000000, 0.0000066100000000, -0.0004926600000000 ] - [ 0.0000114500000000, 0.0000066100000000, -0.0004926600000000 ] - [ 0.0000000000000000, -0.0000132300000000, -0.0004926600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004936500000000 ] - [ -0.0001595000000000, -0.0000920900000000, -0.0003945700000000 ] - [ 0.0001595000000000, -0.0000920900000000, -0.0003945700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001732600000000 ] - [ 0.0000000000000000, 0.0001841800000000, -0.0003945700000000 ]- atom: 21 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ -0.0000680500000000, -0.0000392900000000, -0.0004051600000000 ] - [ 0.0000680500000000, -0.0000392900000000, -0.0004051600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000671000000000 ] - [ 0.0000000000000000, 0.0000785700000000, -0.0004051600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0016438500000000 ] - [ 0.0000000000000000, -0.0000169500000000, -0.0000544900000000 ] - [ 0.0000146800000000, 0.0000084800000000, -0.0000544900000000 ] - [ -0.0000146800000000, 0.0000084800000000, -0.0000544900000000 ] - [ -0.0000128700000000, 0.0000074300000000, -0.0002986500000000 ] - [ 0.0000128700000000, 0.0000074300000000, -0.0002986500000000 ] - [ 0.0000000000000000, -0.0000148700000000, -0.0002986500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002823700000000 ] - [ -0.0017826200000000, 0.0010292000000000, -0.0005583100000000 ] - [ 0.0017826200000000, 0.0010292000000000, -0.0005583100000000 ] - [ 0.0000000000000000, -0.0020583900000000, -0.0005583100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001374000000000 ] - [ 0.0003795000000000, -0.0002191000000000, -0.0000769700000000 ] - [ -0.0003795000000000, -0.0002191000000000, -0.0000769700000000 ] - [ 0.0000000000000000, 0.0004382000000000, -0.0000769700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001130700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0174888900000000 ] - [ 0.0000000000000000, 0.0001438400000000, 0.0005325400000000 ] - [ -0.0001245700000000, -0.0000719200000000, 0.0005325400000000 ] - [ 0.0001245700000000, -0.0000719200000000, 0.0005325400000000 ] - [ 0.0017136400000000, 0.0009893700000000, 0.0000159500000000 ] - [ -0.0017136400000000, 0.0009893700000000, 0.0000159500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004758600000000 ] - [ 0.0000000000000000, -0.0019787500000000, 0.0000159500000000 ] - [ 0.0002824200000000, 0.0001630500000000, -0.0001762100000000 ] - [ -0.0002824200000000, 0.0001630500000000, -0.0001762100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000632000000000 ] - [ 0.0000000000000000, -0.0003261100000000, -0.0001762100000000 ] - [ 0.0000185000000000, 0.0000106800000000, -0.0000708100000000 ] - [ -0.0000185000000000, 0.0000106800000000, -0.0000708100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000526600000000 ] - [ 0.0000000000000000, -0.0000213700000000, -0.0000708100000000 ] - [ 0.0001379700000000, -0.0000796600000000, -0.0002512400000000 ] - [ -0.0001379700000000, -0.0000796600000000, -0.0002512400000000 ] - [ 0.0000000000000000, 0.0001593100000000, -0.0002512400000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002052700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003432500000000 ] - [ 0.0000000000000000, 0.0000117400000000, -0.0001552700000000 ] - [ -0.0000101700000000, -0.0000058700000000, -0.0001552700000000 ] - [ 0.0000101700000000, -0.0000058700000000, -0.0001552700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001448800000000 ] - [ 0.0000000000000000, 0.0000151100000000, -0.0001416300000000 ] - [ -0.0000130800000000, -0.0000075500000000, -0.0001416300000000 ] - [ 0.0000130800000000, -0.0000075500000000, -0.0001416300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0020217000000000 ] - [ 0.0000000000000000, 0.0000648800000000, -0.0000439600000000 ] - [ -0.0000561900000000, -0.0000324400000000, -0.0000439600000000 ] - [ 0.0000561900000000, -0.0000324400000000, -0.0000439600000000 ] - [ 0.0000154300000000, 0.0000089100000000, -0.0002516500000000 ] - [ -0.0000154300000000, 0.0000089100000000, -0.0002516500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002052400000000 ] - [ 0.0000000000000000, -0.0000178200000000, -0.0002516500000000 ] - [ -0.0000437400000000, 0.0000252500000000, -0.0002304100000000 ] - [ 0.0000437400000000, 0.0000252500000000, -0.0002304100000000 ] - [ 0.0000000000000000, -0.0000505100000000, -0.0002304100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002214400000000 ] - [ -0.0008439100000000, -0.0004872300000000, -0.0017093600000000 ] - [ 0.0008439100000000, -0.0004872300000000, -0.0017093600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004196200000000 ] - [ 0.0000000000000000, 0.0009744600000000, -0.0017093600000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0068269000000000 ] - [ 0.0000000000000000, -0.0000127100000000, -0.0003235700000000 ] - [ 0.0000110000000000, 0.0000063500000000, -0.0003235700000000 ] - [ -0.0000110000000000, 0.0000063500000000, -0.0003235700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0017064900000000 ] - [ 0.0000000000000000, 0.0000053600000000, 0.0000889200000000 ] - [ -0.0000046500000000, -0.0000026800000000, 0.0000889200000000 ] - [ 0.0000046500000000, -0.0000026800000000, 0.0000889200000000 ] - [ -0.0000325100000000, 0.0000187700000000, 0.0005071500000000 ] - [ 0.0000325100000000, 0.0000187700000000, 0.0005071500000000 ] - [ 0.0000000000000000, -0.0000375400000000, 0.0005071500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004346600000000 ] - [ 0.0000115000000000, -0.0000066400000000, 0.0004455300000000 ] - [ -0.0000115000000000, -0.0000066400000000, 0.0004455300000000 ] - [ 0.0000000000000000, 0.0000132800000000, 0.0004455300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004498200000000 ] - [ 0.0001624600000000, 0.0000937900000000, 0.0004201700000000 ] - [ -0.0001624600000000, 0.0000937900000000, 0.0004201700000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001783400000000 ] - [ 0.0000000000000000, -0.0001875900000000, 0.0004201700000000 ]- atom: 61 displacement: [ 0.0100000000000000, 0.0000000000000000, 0.0000000000000000 ] forces: - [ 0.0073129400000000, -0.0000069100000000, 0.0002219400000000 ] - [ 0.0005431800000000, -0.0000003600000000, 0.0000030400000000 ] - [ 0.0000347100000000, -0.0002930300000000, 0.0000487500000000 ] - [ 0.0000348000000000, 0.0002939900000000, -0.0000443600000000 ] - [ 0.0000121000000000, 0.0000556200000000, -0.0001488400000000 ] - [ 0.0000119600000000, -0.0000557600000000, 0.0001529200000000 ] - [ 0.0000243800000000, -0.0000000200000000, 0.0000035800000000 ] - [ -0.0000844200000000, -0.0000001600000000, 0.0000029000000000 ] - [ 0.0000130400000000, -0.0000002700000000, -0.0000023700000000 ] - [ 0.0000047300000000, 0.0000000900000000, -0.0000055900000000 ] - [ -0.0000136200000000, 0.0000152800000000, -0.0000223900000000 ] - [ -0.0000130200000000, -0.0000151800000000, 0.0000136300000000 ] - [ 0.0010616600000000, -0.0000071400000000, -0.0000301400000000 ] - [ -0.0001797500000000, -0.0000022300000000, -0.0000345300000000 ] - [ 0.0041291000000000, -0.0017779100000000, -0.0014335200000000 ] - [ 0.0039830600000000, 0.0016804200000000, 0.0013031400000000 ] - [ 0.0001396600000000, -0.0000000400000000, 0.0000342700000000 ] - [ -0.0001330200000000, 0.0000000800000000, 0.0000345800000000 ] - [ -0.0000152700000000, 0.0000901900000000, -0.0000622900000000 ] - [ -0.0000153200000000, -0.0000887000000000, 0.0001311200000000 ] - [ 0.0032186800000000, 0.0013321300000000, 0.0008461500000000 ] - [ 0.0031138000000000, -0.0012568800000000, -0.0008251100000000 ] - [ -0.0002410900000000, 0.0000015800000000, -0.0000149400000000 ] - [ 0.0009246000000000, 0.0000046600000000, -0.0000172000000000 ] - [ 0.0007830600000000, 0.0000008300000000, 0.0000146100000000 ] - [ -0.0003392000000000, -0.0000000700000000, 0.0000151300000000 ] - [ -0.0000077800000000, 0.0001903500000000, 0.0000051600000000 ] - [ -0.0000082900000000, -0.0001921600000000, 0.0000263900000000 ] - [ 0.0000959800000000, -0.0000001500000000, -0.0000356500000000 ] - [ -0.0000898400000000, -0.0000003200000000, -0.0000356800000000 ] - [ 0.0000076800000000, 0.0000556500000000, -0.0000090500000000 ] - [ 0.0000075100000000, -0.0000569200000000, -0.0000619800000000 ] - [ -0.0000045600000000, 0.0000004700000000, 0.0000346300000000 ] - [ 0.0000095100000000, 0.0000005400000000, 0.0000345700000000 ] - [ 0.0000003700000000, -0.0000048100000000, 0.0000328100000000 ] - [ 0.0000005700000000, 0.0000056500000000, 0.0000364100000000 ] - [ 0.0000527300000000, 0.0000002600000000, -0.0000169800000000 ] - [ -0.0000491600000000, 0.0000002400000000, -0.0000167900000000 ] - [ 0.0000021400000000, 0.0000296700000000, -0.0000283300000000 ] - [ 0.0000020200000000, -0.0000287900000000, -0.0000053400000000 ] - [ 0.0000032500000000, 0.0000012900000000, -0.0000173300000000 ] - [ 0.0000031300000000, -0.0000018700000000, 0.0000478200000000 ] - [ 0.0000066800000000, -0.0000002900000000, 0.0000153500000000 ] - [ 0.0000004300000000, -0.0000003900000000, 0.0000154000000000 ] - [ 0.0000066400000000, 0.0000111100000000, -0.0000548500000000 ] - [ 0.0000067500000000, -0.0000116600000000, -0.0000163800000000 ] - [ 0.0000186200000000, -0.0000005500000000, -0.0000353900000000 ] - [ -0.0000130400000000, -0.0000004900000000, -0.0000355800000000 ] - [ -0.0007641500000000, -0.0006498100000000, 0.0012663700000000 ] - [ -0.0007715300000000, 0.0006502600000000, -0.0011910600000000 ] - [ -0.0001809500000000, 0.0000018600000000, 0.0000361700000000 ] - [ 0.0003580900000000, -0.0000036000000000, 0.0000346500000000 ] - [ -0.0001972500000000, 0.0000004500000000, -0.0000198300000000 ] - [ 0.0000466300000000, 0.0000004300000000, -0.0000158200000000 ] - [ 0.0000040900000000, -0.0000241600000000, -0.0000111500000000 ] - [ 0.0000041900000000, 0.0000248700000000, -0.0000216200000000 ] - [ -0.0000773100000000, 0.0000020000000000, 0.0000152700000000 ] - [ -0.0000011000000000, -0.0000008900000000, 0.0000161500000000 ] - [ 0.0000092800000000, -0.0000498300000000, 0.0001765700000000 ] - [ 0.0000040600000000, 0.0000472200000000, -0.0001444500000000 ] - [ -0.0222920700000000, 0.0000331600000000, -0.0002191600000000 ] - [ 0.0029000600000000, 0.0000074700000000, -0.0000185100000000 ] - [ 0.0001499200000000, -0.0015858700000000, 0.0001438700000000 ] - [ 0.0001472100000000, 0.0015750800000000, -0.0002072300000000 ] - [ 0.0000437200000000, 0.0000901200000000, 0.0006846500000000 ] - [ 0.0000431800000000, -0.0000890900000000, -0.0006382500000000 ] - [ 0.0000375400000000, 0.0000008500000000, 0.0000323700000000 ] - [ -0.0001116100000000, 0.0000001200000000, 0.0000235500000000 ] - [ 0.0000028500000000, -0.0000155600000000, 0.0002338000000000 ] - [ 0.0000026800000000, 0.0000146500000000, -0.0002858900000000 ] - [ -0.0000052300000000, -0.0000002000000000, -0.0000211200000000 ] - [ 0.0000291000000000, -0.0000005900000000, -0.0000219700000000 ] - [ -0.0000175800000000, 0.0000006900000000, 0.0000397800000000 ] - [ 0.0000150400000000, 0.0000006900000000, 0.0000245600000000 ] - [ 0.0000044700000000, -0.0000120000000000, 0.0000729700000000 ] - [ 0.0000040600000000, 0.0000131100000000, -0.0000206500000000 ] - [ 0.0000294400000000, 0.0000000900000000, -0.0000399800000000 ] - [ -0.0000062500000000, 0.0000001300000000, -0.0000125900000000 ] - [ 0.0000021700000000, 0.0000136800000000, 0.0000721000000000 ] - [ 0.0000036000000000, -0.0000153600000000, -0.0001114800000000 ] - [ -0.0039131100000000, 0.0000026200000000, 0.0000182600000000 ] - [ 0.0000985300000000, 0.0000001500000000, 0.0000128300000000 ] - [ 0.0000180000000000, -0.0000451400000000, -0.0000253700000000 ] - [ 0.0000181300000000, 0.0000453400000000, 0.0000585200000000 ]- atom: 61 displacement: [ 0.0000000000000000, 0.0000000000000000, 0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, 0.0920006800000000 ] - [ 0.0000000000000000, -0.0000492600000000, 0.0018409400000000 ] - [ 0.0000426600000000, 0.0000246300000000, 0.0018409400000000 ] - [ -0.0000426600000000, 0.0000246300000000, 0.0018409400000000 ] - [ 0.0002690900000000, 0.0001553600000000, -0.0008131700000000 ] - [ -0.0002690900000000, 0.0001553600000000, -0.0008131700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003206600000000 ] - [ 0.0000000000000000, -0.0003107200000000, -0.0008131700000000 ] - [ 0.0000000000000000, -0.0001295400000000, -0.0006921900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004964200000000 ] - [ -0.0001121900000000, 0.0000647700000000, -0.0006921900000000 ] - [ 0.0001121900000000, 0.0000647700000000, -0.0006921900000000 ] - [ 0.0000000000000000, -0.0009189000000000, 0.0023240500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005787400000000 ] - [ -0.0007957900000000, 0.0004594500000000, 0.0023240500000000 ] - [ 0.0007957900000000, 0.0004594500000000, 0.0023240500000000 ] - [ 0.0000000000000000, -0.0003394800000000, -0.0003008800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000127400000000 ] - [ -0.0002940000000000, 0.0001697400000000, -0.0003008800000000 ] - [ 0.0002940000000000, 0.0001697400000000, -0.0003008800000000 ] - [ 0.0007095700000000, 0.0004096700000000, 0.0016611000000000 ] - [ -0.0007095700000000, 0.0004096700000000, 0.0016611000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003944700000000 ] - [ 0.0000000000000000, -0.0008193400000000, 0.0016611000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0071879900000000 ] - [ 0.0000000000000000, 0.0001476500000000, 0.0003743100000000 ] - [ -0.0001278700000000, -0.0000738300000000, 0.0003743100000000 ] - [ 0.0001278700000000, -0.0000738300000000, 0.0003743100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003052600000000 ] - [ 0.0000000000000000, 0.0001560900000000, -0.0002592800000000 ] - [ -0.0001351800000000, -0.0000780500000000, -0.0002592800000000 ] - [ 0.0001351800000000, -0.0000780500000000, -0.0002592800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0002079500000000 ] - [ 0.0000000000000000, 0.0000773200000000, -0.0001861900000000 ] - [ -0.0000669600000000, -0.0000386600000000, -0.0001861900000000 ] - [ 0.0000669600000000, -0.0000386600000000, -0.0001861900000000 ] - [ 0.0000000000000000, -0.0000716800000000, -0.0004782900000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004796800000000 ] - [ -0.0000620800000000, 0.0000358400000000, -0.0004782900000000 ] - [ 0.0000620800000000, 0.0000358400000000, -0.0004782900000000 ] - [ 0.0000258700000000, 0.0000149400000000, -0.0004604100000000 ] - [ -0.0000258700000000, 0.0000149400000000, -0.0004604100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004028400000000 ] - [ 0.0000000000000000, -0.0000298800000000, -0.0004604100000000 ] - [ 0.0001235500000000, 0.0000713300000000, -0.0002928500000000 ] - [ -0.0001235500000000, 0.0000713300000000, -0.0002928500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001660600000000 ] - [ 0.0000000000000000, -0.0001426600000000, -0.0002928500000000 ] - [ 0.0019304900000000, 0.0011145700000000, 0.0002380800000000 ] - [ -0.0019304900000000, 0.0011145700000000, 0.0002380800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004451400000000 ] - [ 0.0000000000000000, -0.0022291300000000, 0.0002380800000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0017481300000000 ] - [ 0.0000000000000000, 0.0000842100000000, -0.0001324700000000 ] - [ -0.0000729300000000, -0.0000421100000000, -0.0001324700000000 ] - [ 0.0000729300000000, -0.0000421100000000, -0.0001324700000000 ] - [ 0.0000000000000000, 0.0012589800000000, -0.0003852100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0001684300000000 ] - [ 0.0010903100000000, -0.0006294900000000, -0.0003852100000000 ] - [ -0.0010903100000000, -0.0006294900000000, -0.0003852100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.1181132000000000 ] - [ 0.0000000000000000, -0.0001949700000000, -0.0025480900000000 ] - [ 0.0001688500000000, 0.0000974800000000, -0.0025480900000000 ] - [ -0.0001688500000000, 0.0000974800000000, -0.0025480900000000 ] - [ 0.0006638200000000, 0.0003832500000000, 0.0012946000000000 ] - [ -0.0006638200000000, 0.0003832500000000, 0.0012946000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001243900000000 ] - [ 0.0000000000000000, -0.0007665100000000, 0.0012946000000000 ] - [ -0.0000897500000000, -0.0000518200000000, 0.0011466500000000 ] - [ 0.0000897500000000, -0.0000518200000000, 0.0011466500000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005584300000000 ] - [ 0.0000000000000000, 0.0001036300000000, 0.0011466500000000 ] - [ 0.0000000000000000, 0.0000590300000000, 0.0011020100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0008281400000000 ] - [ 0.0000511200000000, -0.0000295100000000, 0.0011020100000000 ] - [ -0.0000511200000000, -0.0000295100000000, 0.0011020100000000 ] - [ 0.0000000000000000, -0.0002963300000000, 0.0011510000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0005611200000000 ] - [ -0.0002566300000000, 0.0001481600000000, 0.0011510000000000 ] - [ 0.0002566300000000, 0.0001481600000000, 0.0011510000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0102432600000000 ] - [ 0.0000000000000000, 0.0000595300000000, -0.0014258600000000 ] - [ -0.0000515500000000, -0.0000297600000000, -0.0014258600000000 ] - [ 0.0000515500000000, -0.0000297600000000, -0.0014258600000000 ]- atom: 61 displacement: [ 0.0000000000000000, 0.0000000000000000, -0.0100000000000000 ] forces: - [ 0.0000000000000000, 0.0000000000000000, -0.0961754800000000 ] - [ 0.0000000000000000, 0.0000496000000000, -0.0018525800000000 ] - [ -0.0000429500000000, -0.0000248000000000, -0.0018525800000000 ] - [ 0.0000429500000000, -0.0000248000000000, -0.0018525800000000 ] - [ -0.0002680300000000, -0.0001547500000000, 0.0008180200000000 ] - [ 0.0002680300000000, -0.0001547500000000, 0.0008180200000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0003274100000000 ] - [ 0.0000000000000000, 0.0003095000000000, 0.0008180200000000 ] - [ 0.0000000000000000, 0.0001302700000000, 0.0006870800000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004905200000000 ] - [ 0.0001128200000000, -0.0000651300000000, 0.0006870800000000 ] - [ -0.0001128200000000, -0.0000651300000000, 0.0006870800000000 ] - [ 0.0000000000000000, 0.0009156800000000, -0.0023874500000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0006498000000000 ] - [ 0.0007930000000000, -0.0004578400000000, -0.0023874500000000 ] - [ -0.0007930000000000, -0.0004578400000000, -0.0023874500000000 ] - [ 0.0000000000000000, 0.0003373800000000, 0.0003687900000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000578000000000 ] - [ 0.0002921800000000, -0.0001686900000000, 0.0003687900000000 ] - [ -0.0002921800000000, -0.0001686900000000, 0.0003687900000000 ] - [ -0.0006941000000000, -0.0004007400000000, -0.0016861700000000 ] - [ 0.0006941000000000, -0.0004007400000000, -0.0016861700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0004174500000000 ] - [ 0.0000000000000000, 0.0008014800000000, -0.0016861700000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0068420500000000 ] - [ 0.0000000000000000, -0.0001481000000000, -0.0003377400000000 ] - [ 0.0001282600000000, 0.0000740500000000, -0.0003377400000000 ] - [ -0.0001282600000000, 0.0000740500000000, -0.0003377400000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002356200000000 ] - [ 0.0000000000000000, -0.0001557300000000, 0.0001903100000000 ] - [ 0.0001348600000000, 0.0000778600000000, 0.0001903100000000 ] - [ -0.0001348600000000, 0.0000778600000000, 0.0001903100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0002780700000000 ] - [ 0.0000000000000000, -0.0000775900000000, 0.0002562000000000 ] - [ 0.0000672000000000, 0.0000388000000000, 0.0002562000000000 ] - [ -0.0000672000000000, 0.0000388000000000, 0.0002562000000000 ] - [ 0.0000000000000000, 0.0000714700000000, 0.0004466300000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004477900000000 ] - [ 0.0000618900000000, -0.0000357300000000, 0.0004466300000000 ] - [ -0.0000618900000000, -0.0000357300000000, 0.0004466300000000 ] - [ -0.0000259000000000, -0.0000149500000000, 0.0004928600000000 ] - [ 0.0000259000000000, -0.0000149500000000, 0.0004928600000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0004355300000000 ] - [ 0.0000000000000000, 0.0000299000000000, 0.0004928600000000 ] - [ -0.0001243300000000, -0.0000717800000000, 0.0002242000000000 ] - [ 0.0001243300000000, -0.0000717800000000, 0.0002242000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0000962300000000 ] - [ 0.0000000000000000, 0.0001435700000000, 0.0002242000000000 ] - [ -0.0019389400000000, -0.0011194500000000, -0.0001759100000000 ] - [ 0.0019389400000000, -0.0011194500000000, -0.0001759100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0003792500000000 ] - [ 0.0000000000000000, 0.0022388900000000, -0.0001759100000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0017204500000000 ] - [ 0.0000000000000000, -0.0000843200000000, 0.0000984800000000 ] - [ 0.0000730200000000, 0.0000421600000000, 0.0000984800000000 ] - [ -0.0000730200000000, 0.0000421600000000, 0.0000984800000000 ] - [ 0.0000000000000000, -0.0012632500000000, 0.0004155000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.0001992600000000 ] - [ -0.0010940100000000, 0.0006316300000000, 0.0004155000000000 ] - [ 0.0010940100000000, 0.0006316300000000, 0.0004155000000000 ] - [ 0.0000000000000000, 0.0000000000000000, 0.1220338800000000 ] - [ 0.0000000000000000, 0.0001941200000000, 0.0025021500000000 ] - [ -0.0001681200000000, -0.0000970600000000, 0.0025021500000000 ] - [ 0.0001681200000000, -0.0000970600000000, 0.0025021500000000 ] - [ -0.0006600500000000, -0.0003810800000000, -0.0012460200000000 ] - [ 0.0006600500000000, -0.0003810800000000, -0.0012460200000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0000711400000000 ] - [ 0.0000000000000000, 0.0007621600000000, -0.0012460200000000 ] - [ 0.0000895000000000, 0.0000516700000000, -0.0011947000000000 ] - [ -0.0000895000000000, 0.0000516700000000, -0.0011947000000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0006138000000000 ] - [ 0.0000000000000000, -0.0001033500000000, -0.0011947000000000 ] - [ 0.0000000000000000, -0.0000591200000000, -0.0010539300000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0008017000000000 ] - [ -0.0000512000000000, 0.0000295600000000, -0.0010539300000000 ] - [ 0.0000512000000000, 0.0000295600000000, -0.0010539300000000 ] - [ 0.0000000000000000, 0.0002977700000000, -0.0012050100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0006054900000000 ] - [ 0.0002578700000000, -0.0001488800000000, -0.0012050100000000 ] - [ -0.0002578700000000, -0.0001488800000000, -0.0012050100000000 ] - [ 0.0000000000000000, 0.0000000000000000, -0.0102698200000000 ] - [ 0.0000000000000000, -0.0000600800000000, 0.0014737400000000 ] - [ 0.0000520300000000, 0.0000300400000000, 0.0014737400000000 ] - [ -0.0000520300000000, 0.0000300400000000, 0.0014737400000000 ]